dodecyl 2-[4,6-bis(1-cyano-2-dodecoxy-2-oxidanylidene-ethyl)-1,3,5-triazin-2-yl]-2-cyano-ethanoate

Systemtic Name: dodecyl 2-[4,6-bis(1-cyano-2-dodecoxy-2-oxidanylidene-ethyl)-1,3,5-triazin-2-yl]-2-cyano-ethanoate Openeye Name: dodecyl 2-[4,6-bis(1-cyano-2-dodecoxy-2-oxo-ethyl)-1,3,5-triazin-2-yl]-2-cyano-acetate CAS Name: 2-[4,6-bis(1-cyano-2-dodecoxy-2-oxoethyl)-1,3,5-triazin-2-yl]-2-cyanoacetic acid dodecyl ester IUPAC Name: dodecyl 2-[4,6-bis(1-cyano-2-dodecoxy-2-oxoethyl)-1,3,5-triazin-2-yl]-2-cyanoacetate Traditional Name: 2-[4,6-bis(1-cyano-2-keto-2-lauryloxy-ethyl)-s-triazin-2-yl]-2-cyano-acetic acid lauryl ester Formula: C48H78N6O6 MolecularWeight: 835.16952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C#N)C1=NC(=NC(=N1)C(C#N)C(=O)OCCCCCCCCCCCC)C(C#N)C(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(C#N)C1=NC(=NC(=N1)C(C#N)C(=O)OCCCCCCCCCCCC)C(C#N)C(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C48H78N6O6/c1-4-7-10-13-16-19-22-25-28-31-34-58-46(55)40(37-49)43-52-44(41(38-50)47(56)59-35-32-29-26-23-20-17-14-11-8-5-2)54-45(53-43)42(39-51)48(57)60-36-33-30-27-24-21-18-15-12-9-6-3/h40-42H,4-36H2,1-3H3